CAS 1615-94-7|simiarenol

Introduction:Basic information about CAS 1615-94-7|simiarenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Namesimiarenol
CAS Number1615-94-7Molecular Weight426.72
Density1.0±0.1 g/cm3Boiling Point494.5±14.0 °C at 760 mmHg
Molecular FormulaC30H50OMelting Point/
MSDS/Flash Point218.8±12.4 °C

Names

Name(3R,3aR,5aR,5bS,9S,11aS,11bR,13aS,13bR)-3a,5a,8,8,11b,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,9,10,11,11a,12,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol
SynonymMore Synonyms

simiarenol BiologicalActivity

DescriptionSimiarenol is triterpene alcohol isolated from the Hong Kong species of rhododendron simiarum[1].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
References

[1]. H.R. Arthur, et al. The structure of simiarenol from the Hong Kong species of rhododendron simiarum.Tetrahedron Letters. 1965, 6, 14.

Chemical & Physical Properties

Density1.0±0.1 g/cm3
Boiling Point494.5±14.0 °C at 760 mmHg
Molecular FormulaC30H50O
Molecular Weight426.72
Flash Point218.8±12.4 °C
Exact Mass426.386169
PSA20.23000
LogP10.91
Vapour Pressure0.0±2.9 mmHg at 25°C
Index of Refraction1.538
InChIKeyXVXPXUMUGATHPD-JMJRLLIOSA-N
SMILESCC(C)C1CCC2C1(C)CCC1(C)C3CC=C4C(CCC(O)C4(C)C)C3(C)CCC21C

Safety Information

Hazard CodesXi

Synonyms

Simiarenol
1H-Cyclopenta[a]chrysen-9-ol, 2,3,3a,4,5,5a,5b,6,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-3a,5a,8,8,11b,13a-hexamethyl-3-(1-methylethyl)-, (3R,3aR,5aR,5bS,9S,11aS,11bR,13aS,13bR)-
(3R,3aR,5aR,5bS,9S,11aS,11bR,13aS,13bR)-3-Isopropyl-3a,5a,8,8,11b,13a-hexamethyl-2,3,3a,4,5,5a,5b,6,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-ol
(3R,3aR,5aR,5bS,9S,11aS,11bR,13aS,13bR)-3a,5a,8,8,11b,13a-hexamethyl-3-(propan-2-yl)-2,3,3a,4,5,5a,5b,6,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-ol
Simiaren-3beta-ol
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